trans-Sabinol
- Formula: C10H16O
- Molecular weight: 152.2334
- IUPAC Standard InChIKey: MDFQXBNVOAKNAY-UTLUCORTSA-N
- CAS Registry Number: 29606-76-6
- Chemical structure:
This structure is also available as a 2d Mol file or as a computed 3d SD file
The 3d structure may be viewed using Java or Javascript. - Stereoisomers:
- Other names: (E)-Sabinol
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- Other data available:
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Normal alkane RI, non-polar column, temperature ramp
Go To: Top, References, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | DB-5 | RTX-1 | RTX-1 | DB-5 | HP-5 |
Column length (m) | 50. | 60. | 60. | 30. | 30. |
Carrier gas | Nitrogen | Helium | Helium | Helium | He |
Substrate | |||||
Column diameter (mm) | 0.20 | 0.22 | 0.22 | 0.25 | 0.25 |
Phase thickness (μm) | 0.32 | 0.25 | 0.25 | 0.25 | 0.25 |
Tstart (C) | 60. | 60. | 60. | 60. | 50. |
Tend (C) | 220. | 230. | 230. | 300. | 300. |
Heat rate (K/min) | 5. | 2. | 2. | 3. | 5. |
Initial hold (min) | 3. | 5. | |||
Final hold (min) | 30. | 30. | 5. | ||
I | 1140. | 1120. | 1121. | 1111. | 1139. |
Reference | Kazemi and Akhavani, 2009 | Museli, Pau, et al., 2009 | Museli, Pau, et al., 2009 | Moreno, Lima, et al., 2007 | Figuérédo, Cabassu, et al., 2006 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | NB-30 | DB-5 | DB-5 | CP Sil 5 CB | HP-5MS |
Column length (m) | 30. | 30. | 30. | 25. | 30. |
Carrier gas | He | Hydrogen | He | He | |
Substrate | |||||
Column diameter (mm) | 0.2 | 0.25 | 0.25 | 0.25 | 0.25 |
Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.15 | 0.25 |
Tstart (C) | 50. | 70. | 60. | 50. | 60. |
Tend (C) | 250. | 280. | 220. | 230. | 275. |
Heat rate (K/min) | 2. | 4. | 4. | 3. | 4. |
Initial hold (min) | 4. | 4. | |||
Final hold (min) | |||||
I | 1126. | 1139. | 1143. | 1120. | 1141. |
Reference | Orav, Raal, et al., 2006 | Pino, Marbot, et al., 2006 | Morteza-Semnani and Saeedi, 2005 | Ogunwande, Olawore, et al., 2005 | Sajjadi and Ghannadi, 2005 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | DB-1 | DB-1 | HP-5MS | HP-5MS | CP Sil 5 CB |
Column length (m) | 50. | 50. | 30. | 30. | 25. |
Carrier gas | He | He | He | He | |
Substrate | |||||
Column diameter (mm) | 0.25 | 0.22 | 0.25 | 0.25 | 0.25 |
Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
Tstart (C) | 60. | 70. | 60. | 60. | 35. |
Tend (C) | 240. | 220. | 280. | 280. | 280. |
Heat rate (K/min) | 3. | 4. | 4. | 3. | 5. |
Initial hold (min) | 2.5 | ||||
Final hold (min) | |||||
I | 1105. | 1130. | 1139. | 1136. | 1108. |
Reference | Velasco-Negueruela, Pérez-Alonso, et al., 2005 | Palá-Paúl, García-Jiménez, et al., 2004 | Sajjadi and Shahpiri, 2004 | Couladis, Özcan, et al., 2003 | Kanjilal, Kotoky, et al., 2003 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | DB-5 | HP-5 | DB-5 | DB-5 | DB-1 |
Column length (m) | 30. | 30. | 30. | 30. | 50. |
Carrier gas | H2 | He | He | He | N2 |
Substrate | |||||
Column diameter (mm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
Tstart (C) | 60. | 60. | 60. | 60. | 80. |
Tend (C) | 280. | 280. | 240. | 240. | 225. |
Heat rate (K/min) | 4. | 3. | 3. | 3. | 4. |
Initial hold (min) | 10. | ||||
Final hold (min) | 40. | ||||
I | 1140. | 1127. | 1142. | 1140. | 1121. |
Reference | Pino, Marbot, et al., 2003 | Pitarokili, Tzakou, et al., 2003 | Flamini, Ertugrul, et al., 2002 | Kobaisy, Tellez, et al., 2002 | Palá-Paúl, Pérez-Alonso, et al., 2002 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | DB-1 | HP-5 | DB-5 | DB-1 | CP Sil 5 CB |
Column length (m) | 50. | 30. | 30. | 60. | 25. |
Carrier gas | N2 | N2 | He | N2 | |
Substrate | |||||
Column diameter (mm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.25 | |
Tstart (C) | 60. | 60. | 60. | 75. | 60. |
Tend (C) | 240. | 220. | 240. | 220. | 280. |
Heat rate (K/min) | 3. | 5. | 3. | 4. | 5. |
Initial hold (min) | 10. | 1. | |||
Final hold (min) | 8. | ||||
I | 1105. | 1140. | 1140. | 1142. | 1131. |
Reference | Velasco-Negueruela, Pérez-Alonso, et al., 2002 | Gallori, Flamini, et al., 2001 | Tellez, Dayan, et al., 2000 | Bailac, Dellacasa, et al., 1999 | Kaul, Singh, et al., 1993 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
References
Go To: Top, Normal alkane RI, non-polar column, temperature ramp, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Kazemi and Akhavani, 2009
Kazemi, M.; Akhavani, S.,
Constituents of Artemisia tournefortiana Rchb. essential oil from Iran,
J. Appl. Chem. Res., 2009, 3, 10, 1-5. [all data]
Museli, Pau, et al., 2009
Museli, A.; Pau, M.; Desjobert, J.-M.; Foddai, M.; Usai, M.; Costa, J.,
Volatile constituents of Achllea ligustica All. by HS-SPME/GC/GC-MS. Comparison with essential oils obtained by hydrodistillation from Corsica and Sardinia,
Chromatographia, 2009, 69, 5/6, 575-585, https://doi.org/10.1365/s10337-008-0939-1
. [all data]
Moreno, Lima, et al., 2007
Moreno, P.R.H.; Lima, M.E.L.; Sobral, M.; Young, M.C.M.; Cordeiro, I.; Apel, M.A.A.; Limberger, R.P.; Henriques, A.T.,
Essential oil composition of fruit colour varieties of Eugenia brasiliensis Lam.,
Sci. Agr.; (Piracicaba Praz.), 2007, 64, 4, 428-432. [all data]
Figuérédo, Cabassu, et al., 2006
Figuérédo, G.; Cabassu, P.; Chalchat, J.-C.; Pasquier, B.,
Studies of Mediterranean oregano populations. VIII. Chemical composition of essential oils of oreganos of various origins,
Flavour Fragr. J., 2006, 21, 1, 134-139, https://doi.org/10.1002/ffj.1543
. [all data]
Orav, Raal, et al., 2006
Orav, A.; Raal, A.; Arak, E.; Müürisepp, M.; Kailas, T.,
Composition of the essential oil of Artemisia absinthium L. of different geographical origin,
Proc. Est. Acad. Sci. Chem., 2006, 55, 3, 155-165. [all data]
Pino, Marbot, et al., 2006
Pino, J.A.; Marbot, R.; Payo, A.; Chao, D.; Herrera, P.,
Aromatic Plants from Western Cuba VII. Composition of the Leaf Oil of Psidium wrightii KRug et Urb., Lantana involucrata L., Cinnamonum montanum (Sw.) Berchtold et J. Persl. and Caesalpinia violacea (Mill.) Standley,
J. Essent. Oil. Res., 2006, 18, 2, 170-174, https://doi.org/10.1080/10412905.2006.9699058
. [all data]
Morteza-Semnani and Saeedi, 2005
Morteza-Semnani, K.; Saeedi, M.,
The essential oil composition of Phlomis bruguieri Desf. from Iran,
Flavour Fragr. J., 2005, 20, 3, 344-346, https://doi.org/10.1002/ffj.1459
. [all data]
Ogunwande, Olawore, et al., 2005
Ogunwande, I.A.; Olawore, N.O.; Adeleke, K.A.; Ekundayo, O.,
Volatile constituents from the leaves of Eucalyptus cloeziana F. Muell and E. propinqua Deane Maiden from Nigeria,
Flavour Fragr. J., 2005, 20, 6, 637-639, https://doi.org/10.1002/ffj.1516
. [all data]
Sajjadi and Ghannadi, 2005
Sajjadi, S.-E.; Ghannadi, A.,
Essential oil of the Persian sage, Salvia rhytidea Benth.,
Acta Pharm. Sin., 2005, 55, 321-326. [all data]
Velasco-Negueruela, Pérez-Alonso, et al., 2005
Velasco-Negueruela, A.; Pérez-Alonso, M.J.; Palá-Paúl, J.; Iñigo, A.; López, G.,
The volatile oil composition of the berries of Juniperus macrocarpa Sibth. and Sm., gathered in Spain,
J. Essent. Oil Res., 2005, 17, 1, 61-63, https://doi.org/10.1080/10412905.2005.9698831
. [all data]
Palá-Paúl, García-Jiménez, et al., 2004
Palá-Paúl, J.; García-Jiménez, R.; Pérez-Alonso, M.J.; Velasco-Negueruela, A.; Sanz, J.,
Essential oil composition of the leaves and stems of Meum athamanticum Jacq., from Spain,
J. Chromatogr. A, 2004, 1036, 2, 245-247, https://doi.org/10.1016/j.chroma.2004.02.064
. [all data]
Sajjadi and Shahpiri, 2004
Sajjadi, S.E.; Shahpiri, Z.,
Chemical composition of the essential oil of Salvia limbata C.A.Mey,
DARU, 2004, 12, 3, 94-97. [all data]
Couladis, Özcan, et al., 2003
Couladis, M.; Özcan, M.; Tzakou, O.; Akgül, A.,
Comparative essential oil composition of various parts of the turpentine tree (Pistacia terebinthus L) growing wild in Turkey,
J. Sci. Food Agric., 2003, 83, 2, 136-138, https://doi.org/10.1002/jsfa.1295
. [all data]
Kanjilal, Kotoky, et al., 2003
Kanjilal, P.B.; Kotoky, R.; Singh, R.S.,
Chemical composition of the leaf oil of Altingia excelsa Nornha,
Flavour Fragr. J., 2003, 18, 5, 449-450, https://doi.org/10.1002/ffj.1250
. [all data]
Pino, Marbot, et al., 2003
Pino, J.A.; Marbot, R.; Fuentes, V.,
Characterization of volatiles in Bullock's heart (Annona reticulata L.) fruit cultivars from Cuba,
J. Agric. Food Chem., 2003, 51, 13, 3836-3839, https://doi.org/10.1021/jf020733y
. [all data]
Pitarokili, Tzakou, et al., 2003
Pitarokili, D.; Tzakou, O.; Loukis, A.; Harvala, C.,
Volatile metabolites from Salvia fruticosa as antifungal agents in soilborne pathogens,
J. Agric. Food Chem., 2003, 51, 11, 3294-3301, https://doi.org/10.1021/jf0211534
. [all data]
Flamini, Ertugrul, et al., 2002
Flamini, G.; Ertugrul, K.; Cioni, P.L.; Morelli, I.; Dural, H.; Bagci, Y.,
Volatile constituents of two endemic Centaurea species from Turkey: C. pseudoscabiosa subsp. pseudoscabiosa and C. hadimensis,
Biochem. Syst. Ecol., 2002, 30, 10, 953-959, https://doi.org/10.1016/S0305-1978(02)00043-1
. [all data]
Kobaisy, Tellez, et al., 2002
Kobaisy, M.; Tellez, M.R.; Dayan, F.E.; Duke, S.O.,
Phytotoxicity and volatile constituents from leaves of Callicarpa japonica Thunb.,
Phytochemistry, 2002, 61, 1, 37-40, https://doi.org/10.1016/S0031-9422(02)00207-8
. [all data]
Palá-Paúl, Pérez-Alonso, et al., 2002
Palá-Paúl, J.; Pérez-Alonso, M.J.; Velasco-Negueruela, A.; Sanz, J.,
Analysis by gas chromatography-mass spectrometry of the volatile components of Ageratina adenophora Spreng., growing in the Canary Islands,
J. Chromatogr. A, 2002, 947, 2, 327-331, https://doi.org/10.1016/S0021-9673(02)00016-X
. [all data]
Velasco-Negueruela, Pérez-Alonso, et al., 2002
Velasco-Negueruela, A.; Pérez-Alonso, M.J.; Palá-Paúl, J.; Íñigo, A.; López, G.,
Leaf essential oils analysis of Juniperus navicularis Gandoger,
Botanica Complutensis, 2002, 26, 85-91. [all data]
Gallori, Flamini, et al., 2001
Gallori, S.; Flamini, G.; Bilia, A.R.; Morelli, I.; Landini, A.; Vincieri, F.F.,
Chemical composition of some traditional herbal drug preparations: essential oil and aromatic water of costmary (Balsamita suaveolens Pers.),
J. Agric. Food Chem., 2001, 49, 12, 5907-5910, https://doi.org/10.1021/jf0107656
. [all data]
Tellez, Dayan, et al., 2000
Tellez, M.R.; Dayan, F.E.; Schrader, K.K.; Wedge, D.E.; Duke, S.O.,
Composition and some biological activities of the essential oils of Callicarpa Americana (L.),
J. Agric. Food Chem., 2000, 48, 7, 3008-3012, https://doi.org/10.1021/jf991026g
. [all data]
Bailac, Dellacasa, et al., 1999
Bailac, P.N.; Dellacasa, A.D.; Duschatzky, C.B.; Firpo, N.; Ponzi, M.I.,
Composicion del aceite esencial y actividad antimicrobiana de Aloysia gratissima de San Luis - Argentina,
An. Asoc. Quim. Argent., 1999, 87, 3/4, 149-153. [all data]
Kaul, Singh, et al., 1993
Kaul, V.K.; Singh, B.; Sood, R.P.,
Volatile Constituents of the Essential Oil of Tanacetum longifolium Wall.,
J. Essent. Oil Res., 1993, 5, 6, 597-601, https://doi.org/10.1080/10412905.1993.9698290
. [all data]
Notes
Go To: Top, Normal alkane RI, non-polar column, temperature ramp, References
- Symbols used in this document:
Tend Final temperature Tstart Initial temperature - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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